Home Carboxys 1-(methoxymethyl)cyclohexane-1-carboxylic acid

1-(methoxymethyl)cyclohexane-1-carboxylic acid

CAS No.:
72335-53-6
Catalog Number:
AG01B7HA
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B7HA
Chemical Name:
1-(methoxymethyl)cyclohexane-1-carboxylic acid
CAS Number:
72335-53-6
Molecular Formula:
C9H16O3
Molecular Weight:
172.2215
MDL Number:
MFCD19374575
IUPAC Name:
1-(methoxymethyl)cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C9H16O3/c1-12-7-9(8(10)11)5-3-2-4-6-9/h2-7H2,1H3,(H,10,11)
InChI Key:
OLRBFBRCLMFLBD-UHFFFAOYSA-N
SMILES:
COCC1(CCCCC1)C(=O)O
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.11g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.224g/mol
Monoisotopic Mass:
172.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties